Toluene → HCID 24859388, compound
Reaction equation
[Br:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1.[CH3:33][CH2:34][O:35][C:36]([CH3:37])=[O:38].[CH3:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[CH:1]1([N:4]([C:5]([c:6]2[cH:7][cH:8][c:9]([C:12]([C:13]([F:14])([F:15])[F:16])([CH3:17])[OH:18])[cH:10][cH:11]2)=[O:19])[CH:20]2[CH2:21][CH2:22][NH:23][CH2:24][CH2:25]2)[CH2:2][CH2:3]1.[O:48]=[C:49]([CH:50]=[CH:51][c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1)[CH:58]=[CH:59][c:60]1[cH:61][cH:62][cH:63][cH:64][cH:65]1.[O:66]=[C:67]([CH:68]=[CH:69][c:70]1[cH:71][cH:72][cH:73][cH:74][cH:75]1)[CH:76]=[CH:77][c:78]1[cH:79][cH:80][cH:81][cH:82][cH:83]1.[O:84]=[C:85]([CH:86]=[CH:87][c:88]1[cH:89][cH:90][cH:91][cH:92][cH:93]1)[CH:94]=[CH:95][c:96]1[cH:97][cH:98][cH:99][cH:100][cH:101]1.[Pd:46].[Pd:47]>>[CH:1]1([N:4]([C:5]([c:6]2[cH:7][cH:8][c:9]([C:12]([C:13]([F:14])([F:15])[F:16])([CH3:17])[OH:18])[cH:10][cH:11]2)=[O:19])[CH:20]2[CH2:21][CH2:22][N:23]([c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[CH2:24][CH2:25]2)[CH2:2][CH2:3]1Participants
7
Sources & evidence
- ORD record
- ord-75020b9769bb4eac9d7a00f44692171c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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